Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 3/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.35 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.35 |
| ▸ | DHFR | P00374 | 1/20 | 0.35 |
| ▸ | MPO | P05164 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL11541431 | 0.86 | TP53 (0.39) | ALDH1A1LMNAMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL11512711 | 0.84 | NCEH1 (0.33) | — | |
| SCHEMBL11542387 | 0.83 | TAS1R3 (0.33) | ALDH1A1LMNAMEN1KMT2AMAPK1 | |
| SCHEMBL11542649 | 0.83 | MAPT (0.41) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| SCHEMBL11542216 | 0.82 | NLRP3 (0.36) | ALDH1A1MEN1KMT2ATSHRSMN1; SMN2 | |
| SCHEMBL11542480 | 0.81 | LMNA (0.35) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| SCHEMBL11514546 | 0.80 | NPC1 (0.34) | ALDH1A1LMNAMEN1KMT2AMAPK1 | |
| SCHEMBL11541578 | 0.75 | NCEH1 (0.33) | — | |
| SCHEMBL11541466 | 0.75 | TSHR (0.38) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| SCHEMBL11543045 | 0.75 | PLK1 (0.49) | ALDH1A1MAPK1PTGS1MAPTNPC1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4148799-A | Process for the preparation of 2-aryliminothiazoline solutions | BAYER AKTIENGESELLSCHAFT (DE) | 1979-04-10 | — | — | US | disclosed |